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7-Bromo-5-(2-chloro-phenyl)-3-methoxy-1,3-dihydro-benzo[E][1,4]diazepin-2-one
SpectraBase Compound ID 4lOh4lNJYvj
InChI InChI=1S/C16H12BrClN2O2/c1-22-16-15(21)19-13-7-6-9(17)8-11(13)14(20-16)10-4-2-3-5-12(10)18/h2-8,16H,1H3,(H,19,21)
InChIKey ILUCYYABLOSOAB-UHFFFAOYSA-N
Mol Weight 379.64 g/mol
Molecular Formula C16H12BrClN2O2
Exact Mass 377.977068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fr9ZMsN4DfA
Name 7-Bromo-5-(2-chloro-phenyl)-3-methoxy-1,3-dihydro-benzo[E][1,4]diazepin-2-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 377.977068332 u
Formula C16H12BrClN2O2
InChI InChI=1S/C16H12BrClN2O2/c1-22-16-15(21)19-13-7-6-9(17)8-11(13)14(20-16)10-4-2-3-5-12(10)18/h2-8,16H,1H3,(H,19,21)
InChIKey ILUCYYABLOSOAB-UHFFFAOYSA-N
Molecular Weight 379.641 g/mol
SMILES C1(=NC(C(=O)NC2=C1C=C(Br)C=C2)OC)C1=C(Cl)C=CC=C1